Nombre: (R)-tert-butyl (4-(8-cyclopentyl-7-ethyl-5-methyl-6-oxo-5,6,7,8-tetrahydropteridin-2-yl)pyridin-3-yl)methylcarbamate
SMILES:
CC[C@@H]1C(=O)N(C)c2cnc(-c3ccncc3CNC(=O)OC(C)(C)C)nc2N1C1CCCC1Molecular Processing
Molecular formula
C25H34N6O3
Molecular weight
466.59
Exact mass
466.2692
XLogP
4.07
TPSA
100.55
H-bond donors
1
H-bond acceptors
7
Rotatable bonds
5
Heavy atoms
34
Rings
4
Aromatic rings
2
Saturated rings
1
Aliphatic rings
2
Stereo centers
1
Undefined stereo
0
Formal charge
0
Heteroatoms
9
Covalent units
1
Fraction Csp3
0.56
Molar refractivity
130.56
Supplementary Information
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